1-benzyl-2-(3H-dibenzothiophen-3-id-4-yl)benzimidazole;tetrakis([4-(2-deuteriopropan-2-yl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane);2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-ethylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-propan-2-ylbenzimidazole;tetrakis(iridium)

C166H160Ge4Ir4N12OS3-8 — CID 160835596

About 1-benzyl-2-(3H-dibenzothiophen-3-id-4-yl)benzimidazole;tetrakis([4-(2-deuteriopropan-2-yl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane);2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-ethylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-propan-2-ylbenzimidazole;tetrakis(iridium)

1-benzyl-2-(3H-dibenzothiophen-3-id-4-yl)benzimidazole;tetrakis([4-(2-deuteriopropan-2-yl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane);2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-ethylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-propan-2-ylbenzimidazole;tetrakis(iridium) (PubChem CID 160835596) has the molecular formula C166H160Ge4Ir4N12OS3-8 and a molecular weight of 3510.80 g/mol. Its IUPAC name is 1-benzyl-2-(3H-dibenzothiophen-3-id-4-yl)benzimidazole;tetrakis([4-(2-deuteriopropan-2-yl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane);2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-ethylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-propan-2-ylbenzimidazole;tetrakis(iridium).

Molecular Properties

• Compound Name: 1-benzyl-2-(3H-dibenzothiophen-3-id-4-yl)benzimidazole;tetrakis([4-(2-deuteriopropan-2-yl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane);2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-ethylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-propan-2-ylbenzimidazole;tetrakis(iridium)
• PubChem CID: 160835596
• Molecular Formula: C166H160Ge4Ir4N12OS3-8
• Molecular Weight: 3510.80 g/mol
• Exact Mass: 3516.84
• IUPAC Name: 1-benzyl-2-(3H-dibenzothiophen-3-id-4-yl)benzimidazole;tetrakis([4-(2-deuteriopropan-2-yl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane);2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-ethylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-propan-2-ylbenzimidazole;tetrakis(iridium)
• SMILES: CC(C)n1c(-c2[c-]ccc3c2sc2ccccc23)nc2ccccc21.CCn1c(-c2[c-]ccc3c2sc2ccccc23)nc2ccccc21.[2H]C([2H])([2H])c1c[c-]c(-c2cc(C([2H])(C)C)c([Ge](C)(C)C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2cc(C([2H])(C)C)c([Ge](C)(C)C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2cc(C([2H])(C)C)c([Ge](C)(C)C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2cc(C([2H])(C)C)c([Ge](C)(C)C)cn2)cc1.[Ir].[Ir].[Ir].[Ir].[c-]1ccc2c(oc3ccccc32)c1-c1nc2ccccc2n1-c1ccccc1.[c-]1ccc2c(sc3ccccc32)c1-c1nc2ccccc2n1Cc1ccccc1
• InChI: InChI=1S/C26H17N2S.C25H15N2O.C22H17N2S.C21H15N2S.4C18H24GeN.4Ir/c1-2-9-18(10-3-1)17-28-23-15-6-5-14-22(23)27-26(28)21-13-8-12-20-19-11-4-7-16-24(19)29-25(20)21;1-2-9-17(10-3-1)27-22-15-6-5-14-21(22)26-25(27)20-13-8-12-19-18-11-4-7-16-23(18)28-24(19)20;1-14(2)24-19-12-5-4-11-18(19)23-22(24)17-10-7-9-16-15-8-3-6-13-20(15)25-21(16)17;1-2-23-18-12-5-4-11-17(18)22-21(23)16-10-7-9-15-14-8-3-6-13-19(14)24-20(15)16;4*1-13(2)16-11-18(15-9-7-14(3)8-10-15)20-12-17(16)19(4,5)6;;;;/h1-12,14-16H,17H2;1-12,14-16H;3-9,11-14H,1-2H3;3-9,11-13H,2H2,1H3;4*7-9,11-13H,1-6H3;;;;/q8*-1;;;;/i;;;;4*3D3,13D
• InChIKey: NKRXPBDJKMCZPD-BDUPUGHFSA-N
• XLogP: 43.75
• TPSA: 135.98 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 25
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3510.80
LogP ≤ 5	43.75
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-2-(3H-dibenzothiophen-3-id-4-yl)benzimidazole;tetrakis([4-(2-deuteriopropan-2-yl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane);2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-ethylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-propan-2-ylbenzimidazole;tetrakis(iridium)?

The IUPAC name of 1-benzyl-2-(3H-dibenzothiophen-3-id-4-yl)benzimidazole;tetrakis([4-(2-deuteriopropan-2-yl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane);2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-ethylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-propan-2-ylbenzimidazole;tetrakis(iridium) (CID 160835596) is 1-benzyl-2-(3H-dibenzothiophen-3-id-4-yl)benzimidazole;tetrakis([4-(2-deuteriopropan-2-yl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane);2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-ethylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-propan-2-ylbenzimidazole;tetrakis(iridium).

What is the SMILES notation for 1-benzyl-2-(3H-dibenzothiophen-3-id-4-yl)benzimidazole;tetrakis([4-(2-deuteriopropan-2-yl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane);2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-ethylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-propan-2-ylbenzimidazole;tetrakis(iridium)?

The canonical SMILES for 1-benzyl-2-(3H-dibenzothiophen-3-id-4-yl)benzimidazole;tetrakis([4-(2-deuteriopropan-2-yl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane);2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-ethylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-propan-2-ylbenzimidazole;tetrakis(iridium) is CC(C)n1c(-c2[c-]ccc3c2sc2ccccc23)nc2ccccc21.CCn1c(-c2[c-]ccc3c2sc2ccccc23)nc2ccccc21.[2H]C([2H])([2H])c1c[c-]c(-c2cc(C([2H])(C)C)c([Ge](C)(C)C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2cc(C([2H])(C)C)c([Ge](C)(C)C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2cc(C([2H])(C)C)c([Ge](C)(C)C)cn2)cc1.[2H]C([2H])([2H])c1c[c-]c(-c2cc(C([2H])(C)C)c([Ge](C)(C)C)cn2)cc1.[Ir].[Ir].[Ir].[Ir].[c-]1ccc2c(oc3ccccc32)c1-c1nc2ccccc2n1-c1ccccc1.[c-]1ccc2c(sc3ccccc32)c1-c1nc2ccccc2n1Cc1ccccc1.

What is the InChIKey of 1-benzyl-2-(3H-dibenzothiophen-3-id-4-yl)benzimidazole;tetrakis([4-(2-deuteriopropan-2-yl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane);2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-ethylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-propan-2-ylbenzimidazole;tetrakis(iridium)?

The InChIKey is NKRXPBDJKMCZPD-BDUPUGHFSA-N. The full InChI is InChI=1S/C26H17N2S.C25H15N2O.C22H17N2S.C21H15N2S.4C18H24GeN.4Ir/c1-2-9-18(10-3-1)17-28-23-15-6-5-14-22(23)27-26(28)21-13-8-12-20-19-11-4-7-16-24(19)29-25(20)21;1-2-9-17(10-3-1)27-22-15-6-5-14-21(22)26-25(27)20-13-8-12-19-18-11-4-7-16-23(18)28-24(19)20;1-14(2)24-19-12-5-4-11-18(19)23-22(24)17-10-7-9-16-15-8-3-6-13-20(15)25-21(16)17;1-2-23-18-12-5-4-11-17(18)22-21(23)16-10-7-9-15-14-8-3-6-13-19(14)24-20(15)16;4*1-13(2)16-11-18(15-9-7-14(3)8-10-15)20-12-17(16)19(4,5)6;;;;/h1-12,14-16H,17H2;1-12,14-16H;3-9,11-14H,1-2H3;3-9,11-13H,2H2,1H3;4*7-9,11-13H,1-6H3;;;;/q8*-1;;;;/i;;;;4*3D3,13D;;;;.

What are the key properties of 1-benzyl-2-(3H-dibenzothiophen-3-id-4-yl)benzimidazole;tetrakis([4-(2-deuteriopropan-2-yl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane);2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-ethylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-propan-2-ylbenzimidazole;tetrakis(iridium)?

1-benzyl-2-(3H-dibenzothiophen-3-id-4-yl)benzimidazole;tetrakis([4-(2-deuteriopropan-2-yl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane);2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-ethylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-propan-2-ylbenzimidazole;tetrakis(iridium) has a molecular weight of 3510.80 g/mol, XLogP of 43.75, 25 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 1-benzyl-2-(3H-dibenzothiophen-3-id-4-yl)benzimidazole;tetrakis([4-(2-deuteriopropan-2-yl)-6-[4-(trideuteriomethyl)benzene-6-id-1-yl]-3-pyridinyl]-trimethylgermane);2-(3H-dibenzofuran-3-id-4-yl)-1-phenylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-ethylbenzimidazole;2-(3H-dibenzothiophen-3-id-4-yl)-1-propan-2-ylbenzimidazole;tetrakis(iridium) is sourced from PubChem (CID 160835596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).